File name: Pandora101s1_Izana_20240406_L2Fit_fout2c22d20230904p1-8.txt File generation date: 20240911T150942.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c22p1-8 Local principal investigator: Alberto Redondas Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 101 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora101_OF_v3d20220624.txt Instrument calibration file used: Pandora101s1_CF_v22d20230904.txt Level 1 file used: Pandora101s1_Izana_20240406_L1_smca1c22d20230904p1-8.txt Full location name: Izana Atmospheric Research Center Short location name: Izana Country of location: Spain Location latitude [deg]: 28.3090 Location longitude [deg]: -16.4994 Location altitude [m]: 2360 Local noon date: 20240406 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are latency correction, matrix method stray light correction (replaced by simple method) Data caveats: Based on session 12 fieldcal with sens applied First and last pixel inside fitting window: 222 363 Nominal wavelengths inside fitting window [nm]: 305.1209 305.2618 305.4026 305.5434 305.6843 305.8251 305.9659 306.1066 306.2474 306.3882 306.5289 306.6697 306.8104 306.9511 307.0918 307.2325 307.3732 307.5139 307.6545 307.7952 307.9358 308.0764 308.2170 308.3576 308.4982 308.6388 308.7794 308.9199 309.0605 309.2010 309.3415 309.4820 309.6225 309.7630 309.9035 310.0440 310.1844 310.3249 310.4653 310.6057 310.7461 310.8865 311.0269 311.1673 311.3076 311.4480 311.5883 311.7287 311.8690 312.0093 312.1496 312.2898 312.4301 312.5704 312.7106 312.8509 312.9911 313.1313 313.2715 313.4117 313.5519 313.6920 313.8322 313.9723 314.1125 314.2526 314.3927 314.5328 314.6729 314.8129 314.9530 315.0931 315.2331 315.3731 315.5131 315.6531 315.7931 315.9331 316.0731 316.2130 316.3530 316.4929 316.6329 316.7728 316.9127 317.0526 317.1924 317.3323 317.4722 317.6120 317.7518 317.8916 318.0315 318.1712 318.3110 318.4508 318.5906 318.7303 318.8701 319.0098 319.1495 319.2892 319.4289 319.5686 319.7082 319.8479 319.9875 320.1272 320.2668 320.4064 320.5460 320.6856 320.8252 320.9647 321.1043 321.2438 321.3833 321.5229 321.6624 321.8019 321.9413 322.0808 322.2203 322.3597 322.4991 322.6386 322.7780 322.9174 323.0568 323.1961 323.3355 323.4749 323.6142 323.7535 323.8928 324.0321 324.1714 324.3107 324.4500 324.5893 324.7285 324.8677 --------------------------------------------------------------------------------------- Column 1: Two letter code of measurement routine Column 2: UT date and time for center-time of measurement, yyyymmddThhmmssZ (ISO 8601) Column 3: Fractional days since 1-Jan-2000 midnight for center-time of measurement Column 4: Routine count (1 for the first routine of the day, 2 for the second, etc.) Column 5: Repetition count (1 for the first set in the routine, 2 for the second, etc.) Column 6: Total duration of measurement set in seconds Column 7: Data processing type index Column 8: Solar zenith angle for center-time of measurement in degree Column 9: Solar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 10: Lunar zenith angle for center-time of measurement in degree Column 11: Lunar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 12: Pointing zenith angle in degree, absolute or relative (see next column), 999=tracker not used Column 13: Zenith pointing mode: zenith angle is... 0=absolute, 1=relative to sun, 2=relative to moon Column 14: Pointing azimuth in degree, increases clockwise, absolute (0=north) or relative (see next column), 999=tracker not used Column 15: Azimuth pointing mode: like zenith angle mode but also fixed scattering angles relative to sun (3) or moon (4) Column 16: Fitting result index: 0=no error or warning, 1, 2=warning, >2=error Column 17: Number of function evaluations used, 0=linear fitting or fitting not successful or no fitting done Column 18: rms of unweighted fitting residuals, -9=fitting not successful Column 19: Normalized rms of fitting residuals weighted with independent uncertainty, -9=fitting not successful or no uncertainty used Column 20: Expected rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 21: Expected normalized weighted rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 22: Ozone slant column amount [moles per square meter], -9e99=fitting not successful Column 23: Independent uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 24: Structured uncertainty of ozone slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 25: Common uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 26: rms-based uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 27: Ozone effective temperature [K] Column 28: Independent uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 29: Structured uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 30: Common uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 31: Effective ozone fitting wavelength [nm], -9=fitting not successful Column 32: Diffuse correction applied before fitting at effective fitting wavelength for ozone [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 33: Sulfur dioxide slant column amount [moles per square meter], -9e99=fitting not successful Column 34: Independent uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 35: Structured uncertainty of sulfur dioxide slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 36: Common uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 37: rms-based uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 38: Sulfur dioxide effective temperature [K] Column 39: Independent uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 40: Structured uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 41: Common uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 42: Effective sulfur dioxide fitting wavelength [nm], -9=fitting not successful Column 43: Diffuse correction applied before fitting at effective fitting wavelength for sulfur dioxide [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 44: Molecular scattering air mass factor used for molecular scattering subtraction before the fitting Column 45: Estimated uncertainty of molecular scattering air mass factor, -9=molecular scattering was not subtracted before the fitting Column 46: Lower limit used for wavelength scaling [nm] Column 47: Upper limit used for wavelength scaling [nm] Column 48: Order of smoothing polynomial Column 49: Smoothing polynomial coefficient, order 0 Column 50: Independent uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 51: Structured uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 52: Common uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 53: rms-based uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 54: Smoothing polynomial coefficient, order 1 Column 55: Independent uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 56: Structured uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 57: Common uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 58: rms-based uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 59: Smoothing polynomial coefficient, order 2 Column 60: Independent uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 61: Structured uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 62: Common uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 63: rms-based uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 64: Smoothing polynomial coefficient, order 3 Column 65: Independent uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 66: Structured uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 67: Common uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 68: rms-based uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 69: Mean value of measured data inside fitting window [same units as measurements] Column 70: Wavelength change polynomial coefficient, order 0 Column 71: Independent uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 72: Structured uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 73: Common uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 74: rms-based uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 75: L1 based wavelength change coefficient, order 0, -9=no L1 wavelength change determination Column 76: L1 based wavelength change coefficient, order 1, -9=no L1 wavelength change determination Column 77: L2Fit data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 78: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ1 limit, 0=L1 data quality above 0, 1=Spectral fitting was not successful, 2=Wavelength shift too large, 3=Normalized rms of fitting residuals weighted with independent uncertainty too large Column 79: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 80: L1 data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 81: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ1 limit, 0=Saturated data, 1=Too few dark counts measurements, 2=No temperature given or effective temperature too different from the reference temperature, 3=Dark count too high, 4=Unsuccessful dark background fitting, 5=The dark count differs significantly from the dark map for too many pixels, 6=Absolute value of estimated average residual stray light level too high, 7=Although attempted, no wavelength change could be retrieved, 8=Absolute value of retrieved wavelength shift too large, 9=Retrieved wavelength shift differs too much from the shift predicted by the effective temperature Column 82: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 83: Atmospheric variability [%], 999=no atmospheric variability was determined Column 84: Wavelength effective temperature [°C], 999=no effective temperature given Column 85: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 86: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 87: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 88: Number of bright count cycles Column 89: Number of dark count cycles Column 90: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 91: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 92: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 93: Integration time [ms] Column 94: Temperature at electronics board [°C], 999=no temperature signal Column 95: Spectrometer control temperature [°C], 999=no temperature signal Column 96: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 97: Temperature in head sensor [°C], 999=no temperature signal Column 98: Humidity in head sensor [%], -9=no humidity signal Column 99: Pressure in head sensor [hPa], -9=no pressure signal Columns 100-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-383: Normalized slant column residuals weighted with independent instrumental uncertainty for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting, 0=no independent instrumental uncertainty was given --------------------------------------------------------------------------------------- SS 20240406T071922.6Z 8862.305122 76 1 48.30 2 84.42 85.41 67.32 116.16 0.00 1 0.00 1 0 25 3.105e-01 2.608e-02 2.454e-01 1.029e-02 9.685465e-01 5.762458e-03 9.772375e-03 -6.000000e+00 1.757798e-01 227.27 -2.00 3.19 -2.00 321.76 0.00e+00 -1.495045e-02 2.625029e-03 5.276177e-03 -6.000000e+00 7.960852e-03 275.34 -2.00 20.00 -2.00 321.31 0.00e+00 9.108 0.008 302.00 328.00 3 3.6115e+00 1.9360e-02 9.2950e-02 -6.0000e+00 4.3800e-01 1.1770e+00 2.5919e-02 7.8399e-02 -6.0000e+00 4.7533e-01 -1.3149e+00 2.4732e-02 2.7170e-02 -6.0000e+00 2.8150e-01 5.0399e-01 1.2041e-02 1.6620e-02 -6.0000e+00 1.2221e-01 4.6732e-06 -1.2484e-03 2.5511e-04 1.3323e-04 -6.0000e+00 8.2279e-03 3.4780e-03 0.0000e+00 12 8 8 10 0 0 98.26 20.96 0.46 0.00348 -0.00590 42 11 1 5 0 1149.970 20.96 14.98 14.45 14.63 0.0 920.42 -30405 17855 -86337 900000 -119938 92492 -76619 -15904 -48849 900000 -78599 -23979 -27104 11981 -18088 -26081 25650 -21616 -29973 -36016 5401 66813 17174 35915 -130197 40611 35817 -15042 48989 71764 31359 30453 12997 23626 -44658 46393 -7942 29304 38120 73560 35000 70514 43676 60765 9731 22334 12984 11324 47217 5864 26379 24012 26432 43493 43813 37880 41307 27818 29300 5851 4945 6257 16990 17682 4616 14390 6480 12765 5088 16618 10513 13081 7245 13798 3404 -4871 -4717 -2646 -7165 -2757 352 -279 -302 -3500 146 118 1690 -95 237 -4286 -1552 -4517 -2177 -3585 -3250 -1211 -1125 -2217 -3211 -1059 -3308 -1884 -2611 -1321 -4761 -1436 -2486 -1567 -1658 545 -89 473 812 -318 1767 -743 155 -1929 1035 -229 3151 1745 1428 3382 1289 833 -134 1651 1244 705 -248 -127 -1176 513 481 178 517 239 -330 -417 -857 -1690 -483 179 -2310 900000 -3309 928 -1601 -213 -1021 900000 -2431 -481 -657 230 -544 -938 579 -813 -1228 -1536 145 950 445 901 -17483 1086 928 -566 901 1244 891 1018 576 928 -3173 1319 -438 1372 2040 3259 2487 3596 2848 3150 797 1568 999 918 2842 588 2448 2549 3005 4545 4872 4719 5042 3698 3503 822 707 978 2741 3178 972 2707 1360 2732 1357 4501 3234 3948 2186 3507 837 -1157 -1092 -650 -2186 -973 142 -131 -142 -1796 76 64 942 -54 130 -2299 -817 -2364 -1138 -2122 -2092 -904 -981 -2241 -3496 -1098 -3173 -1551 -1992 -1032 -4133 -1263 -2354 -1613 -1963 735 -127 716 1243 -481 2697 -1138 242 -2994 1632 -365 4941 2602 2058 4641 1750 1091 -177 2400 2001 1315 -518 -286 -2864 1326 1242 476 1386 643 -867 -1089 -2048 -3744 SS 20240406T072932.4Z 8862.312180 79 1 25.74 2 82.19 86.59 65.36 117.73 0.00 1 0.00 1 0 17 6.308e-01 1.049e-02 1.042e-01 2.554e-03 8.209083e-01 1.377607e-03 8.444259e-03 -6.000000e+00 3.570261e-01 227.27 -2.00 3.19 -2.00 321.26 0.00e+00 4.322421e-03 6.333397e-04 2.259081e-03 -6.000000e+00 1.525051e-02 275.34 -2.00 20.00 -2.00 320.82 0.00e+00 6.888 0.003 302.00 328.00 3 2.8397e+00 4.4846e-03 6.5875e-02 -6.0000e+00 8.8905e-01 2.3960e-01 6.5117e-03 4.1556e-02 -6.0000e+00 9.6443e-01 -2.9463e-01 7.2534e-03 2.5010e-02 -6.0000e+00 5.7174e-01 1.1536e-01 3.4583e-03 1.0162e-02 -6.0000e+00 2.4715e-01 6.8590e-05 -3.6721e-04 6.3109e-05 1.1498e-04 -6.0000e+00 1.6337e-02 3.5676e-03 0.0000e+00 12 9 9 12 1 1 98.03 20.96 0.28 0.00357 0.00081 123 59 1 5 0 207.570 20.96 14.99 14.45 14.61 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-324 -118 344 -19 340 322 628 82 251 180 656 718 701 941 825 929 1257 1038 1156 1268 899 681 472 715 937 1470 1292 1025 1196 861 880 1522 1528 1438 1290 578 385 -88 -473 -1108 -869 -684 -683 -702 -644 -1151 -969 -553 -195 -165 434 471 508 -61 -759 -917 -930 -983 -591 14 237 93 -457 -974 -1074 -785 -1162 -1445 -1516 -1287 -382 -123 704 752 557 607 -266 -214 -173 171 561 24 43 1205 1161 1428 996 411 -240 665 650 502 621 -192 32 -193 -661 -241 -387 507 493 -246 -312 -472 -1129 SS 20240406T074513.9Z 8862.323077 84 1 12.31 2 78.74 88.43 62.37 120.29 0.00 1 0.00 1 0 17 2.570e-01 6.498e-03 2.260e-02 9.598e-04 6.213316e-01 4.968899e-04 6.511321e-03 -6.000000e+00 1.454579e-01 227.27 -2.00 3.19 -2.00 320.12 0.00e+00 2.008725e-03 1.654846e-04 7.216221e-04 -6.000000e+00 6.213115e-03 275.35 -2.00 20.00 -2.00 319.63 0.00e+00 4.956 0.001 302.00 328.00 3 2.0731e+00 1.4357e-03 4.7696e-02 -6.0000e+00 3.6221e-01 6.0371e-02 1.7794e-03 2.9589e-02 -6.0000e+00 3.9292e-01 -6.9016e-02 1.7158e-03 1.5763e-02 -6.0000e+00 2.3293e-01 2.2345e-02 8.8805e-04 5.5588e-03 -6.0000e+00 1.0070e-01 7.4532e-04 -1.6103e-04 2.4845e-05 5.5230e-05 -6.0000e+00 6.6555e-03 3.0987e-03 0.0000e+00 12 9 1 12 1 1 36.20 20.96 0.24 0.00310 0.00189 277 275 1 5 0 44.260 20.96 14.99 14.44 15.03 0.0 923.49 -90384 -87215 -77046 -88792 -97002 -98978 -86626 -76356 -71988 -75604 -70267 -63445 -47644 -32822 -28395 -17316 -18105 -14482 -13853 -11937 -12839 -12301 -12722 -12242 -15433 -10340 -11258 -14647 -12311 -10771 -2499 -704 -2299 -4900 -6036 -4936 -4358 -761 561 1442 1299 1008 1606 1184 1942 1760 1404 728 1676 2479 2566 2982 3009 2492 2449 1965 802 521 144 834 1111 2145 2815 2056 1229 655 -20 653 1214 1022 817 363 339 -162 -496 -1257 -2277 -1825 -1446 -1333 -1136 -1754 -1819 -1245 -768 -161 294 490 681 722 242 -203 -419 -346 -321 33 458 426 67 -205 -694 -699 -179 -599 -1002 -824 -599 -113 390 339 556 510 236 168 123 130 132 48 -7 -138 73 358 272 265 84 47 434 513 232 52 -217 -204 -159 -335 -59 -66 271 117 -11 -116 -165 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